5-[(2-chloranyl-5-nitro-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: 5-[(2-chloranyl-5-nitro-phenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: 5-[(2-chloro-5-nitro-phenyl)methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: 5-[(2-chloro-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: 5-[(2-chloro-5-nitrophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: 5-(2-chloro-5-nitro-benzylidene)-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C11H6ClN3O4S MolecularWeight: 311.70104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])C=C2C(=O)NC(=S)NC2=O)Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])C=C2C(=O)NC(=S)NC2=O)Cl

InChI

InChI=1S/C11H6ClN3O4S/c12-8-2-1-6(15(18)19)3-5(8)4-7-9(16)13-11(20)14-10(7)17/h1-4H,(H2,13,14,16,17,20)